Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 8/20 | 0.49 |
| ▸ | GRM5 | P41594 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21395157 | 0.94 | CYP3A4 (0.47) | CYP3A4GRM5CYP1A2CYP2C9L3MBTL1 | |
| SCHEMBL29356824 | 0.87 | L3MBTL1 (0.47) | CYP3A4GRM5CYP1A2CYP2C9L3MBTL1 | |
| SCHEMBL21394821 | 0.87 | L3MBTL1 (0.47) | CYP3A4GRM5CYP1A2CYP2C9L3MBTL1 | |
| SCHEMBL29359147 | 0.87 | TSHR (0.47) | CYP3A4GRM5CYP1A2CYP2C9L3MBTL1 | |
| SCHEMBL21394809 | 0.87 | TSHR (0.47) | CYP3A4GRM5CYP1A2CYP2C9L3MBTL1 | |
| SCHEMBL29357070 | 0.86 | L3MBTL1 (0.47) | GRM5L3MBTL1TSHRHTT | |
| SCHEMBL21394806 | 0.86 | L3MBTL1 (0.47) | GRM5L3MBTL1TSHRHTT | |
| SCHEMBL21395074 | 0.83 | CYP3A4 (0.53) | CYP3A4GRM5CYP1A2CYP2C9 | |
| SCHEMBL21394626 | 0.80 | L3MBTL1 (0.46) | GRM5L3MBTL1TSHRHTT | |
| SCHEMBL29357041 | 0.80 | L3MBTL1 (0.46) | GRM5L3MBTL1TSHRHTT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020198026-A1 | COMPOUNDS AND USES THEREOF | YUMANITY THERAPEUTICS, INC. (US) | 2020-10-01 | — | — | WO | disclosed |
| WO-2019183587-A1 | COMPOUNDS AND USES THEREOF | YUMANITY THERAPEUTICS, INC. (US) | 2019-09-26 | — | — | WO | disclosed |